How to cite this WIREs title:
WIREs Comput Mol Sci
WIREs Comput Mol Sci
Introducing:
WIREs Computational Molecular Science
- An important new forum to promote cross-disciplinary research on computational chemistry, biochemistry and materials science
- An authoritative, encyclopedic resource addressing key topics from diverse research perspectives
- Now indexed by TRSI (formerly ISI), Scopus, and CAS: Chemical Abstracts Service
Latest Articles
Editorial Commentary
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Overviews
- Transition metal catalysis by density functional theory and density functional theory/molecular mechanics
- Ab initio calculation of magnetic circular dichroism
Advanced Reviews
- Understanding protein unfolding from molecular simulations
- Density‐functional tight binding—an approximate density‐functional theory method
Focus Articles
- The evolution of the RCSB Protein Data Bank website
- The Cambridge Structural Database: experimental three‐dimensional information on small molecules is a vital resource for interdisciplinary research and learning
Software Focus
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